pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.86	Baltruschat ChEMBL	1	0	CC(C)c1[nH+]nc2ccc(-c3ocnc3-c3ccc(F)cc3)cn12,CC(C)c1nnc2ccc(-c3oc[nH+]c3-c3ccc(F)cc3)cn12,CC(C)c1n[nH+]c2ccc(-c3ocnc3-c3ccc(F)cc3)cn12	CC(C)c1nnc2ccc(-c3ocnc3-c3ccc(F)cc3)cn12	mol16237	CC(C)c1nnc2ccc(-c3ocnc3-c3ccc(F)cc3)cn12